SCHEMBL25869712

SCHEMBL25869712

COS(=O)(=O)OCCC(=O)CCC(=O)c1ccc(CC(C)=O)o1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.34
ALDH1A1 P00352 6/20 0.34
MAPT P10636 4/20 0.34
KDM4E B2RXH2 3/20 0.34
KMT2A Q03164 3/20 0.34
HSD17B10 Q99714 2/20 0.34
MEN1 O00255 2/20 0.34
HPGD P15428 1/20 0.34
POLB P06746 3/20 0.33
RECQL P46063 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
ALOX12 P18054 2/20 0.33
ALOX15 P16050 1/20 0.33
ESR2 Q92731 1/20 0.33
TLR2 O60603 1/20 0.32
NSD2 O96028 1/20 0.32
PKM P14618 1/20 0.32
MPI P34949 1/20 0.32
GRK6 P43250 1/20 0.32
TLR1 Q15399 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25869714 0.84 ERCC5 (0.32) HTTALDH1A1
SCHEMBL25869720 0.81
SCHEMBL25869723 0.81 NPC1 (0.33) HTTALDH1A1KMT2AHSD17B10MEN1
SCHEMBL25869717 0.78 ALDH1A1 (0.35) HTTALDH1A1MAPTKDM4EKMT2A
SCHEMBL23740096 0.76 IAPP (0.41) HTTALDH1A1MAPTKDM4EKMT2A
SCHEMBL22328915 0.76 HTT (0.39) HTTALDH1A1MAPTKDM4EKMT2A
SCHEMBL25869641 0.69 PAOX (0.34) ALDH1A1
SCHEMBL25869644 0.67 ALDH1A1 (0.32) ALDH1A1
SCHEMBL27441378 0.67 KMT2A (0.33) HTTALDH1A1MAPTKDM4EKMT2A
SCHEMBL22328918 0.66 NPC1 (0.37) HTTALDH1A1MAPTKDM4EKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11708324-B2 Sulfuric acid ester or salt thereof, and surfactant DAIKIN INDUSTRIES. LTD. (JP) 2023-07-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11708324-B2 Sulfuric acid ester or salt thereof, and surfactant SRP54, NR4A1, NR4A3 HTT 4551/4885ALDH1A1 3345/4885MAPT 4272/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.